Geometry & MOs

Info

ID:	349785
PubChem CID:	127276177
Reduced:	SN2O3C14H22 (1)
Stoich.:	AB2C3D14E22 (1)
Weight, g/mol:	345.205242
ΔH_f, kcal/mol:	-120.56
Dipole, Da:	5.13
IP(EA), eV:	-9.08(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[2-(oxane-3-carbonylamino)phenyl]methyl]piperidine-3-carboxamide

Drug info:

PubChemData

Smile

C1CC(COC1)C(=O)N2CSCC2C(=O)NCC3CC3

DOS

IR

Vibrations